(3R,4R)-4-oxidanyl-3-[(4-phenylmethoxyphenyl)carbonylamino]-N-propan-2-yl-azepane-1-carboxamide

Systemtic Name: (3R,4R)-4-oxidanyl-3-[(4-phenylmethoxyphenyl)carbonylamino]-N-propan-2-yl-azepane-1-carboxamide Openeye Name: (3R,4R)-3-[(4-benzyloxybenzoyl)amino]-4-hydroxy-N-isopropyl-azepane-1-carboxamide CAS Name: (3R,4R)-4-hydroxy-3-[[oxo-(4-phenylmethoxyphenyl)methyl]amino]-N-propan-2-yl-1-azepanecarboxamide IUPAC Name: (3R,4R)-4-hydroxy-3-[(4-phenylmethoxybenzoyl)amino]-N-propan-2-ylazepane-1-carboxamide Traditional Name: (3R,4R)-3-[(4-benzoxybenzoyl)amino]-4-hydroxy-N-isopropyl-azepane-1-carboxamide Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CCCC(C(C1)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)NC(=O)N1CCC[C@H]([C@@H](C1)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)O

InChI

InChI=1S/C24H31N3O4/c1-17(2)25-24(30)27-14-6-9-22(28)21(15-27)26-23(29)19-10-12-20(13-11-19)31-16-18-7-4-3-5-8-18/h3-5,7-8,10-13,17,21-22,28H,6,9,14-16H2,1-2H3,(H,25,30)(H,26,29)/t21-,22-/m1/s1